Cas no 908590-74-9 (1,3-Benzenediamine, N1,N3-diethyl-2-nitro-)
908590-74-9 structure
Product Name:1,3-Benzenediamine, N1,N3-diethyl-2-nitro-
CAS No:908590-74-9
MF:C10H15N3O2
MW:209.245002031326
CID:797968
Update Time:2024-02-02
1,3-Benzenediamine, N1,N3-diethyl-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenediamine, N1,N3-diethyl-2-nitro-
- 1,3-Benzenediamine, N1,N3-diethyl-2-nitro-
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- Inchi： 1S/C10H15N3O2/c1-3-11-8-6-5-7-9(12-4-2)10(8)13(14)15/h5-7,11-12H,3-4H2,1-2H3
- InChI Key： HWLIJCPKRLCVPW-UHFFFAOYSA-N
- SMILES： C1(NCC)=CC=CC(NCC)=C1[N+]([O-])=O
Computed Properties
- Exact Mass: 209.116
- Monoisotopic Mass: 209.116
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 191
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 69.9A^2
1,3-Benzenediamine, N1,N3-diethyl-2-nitro- Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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